6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one

C19H17ClN2O2 — CID 701068

IUPAC6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one
SMILESO=c1[nH]c2ccc(Cl)cc2c(-c2ccccc2)c1N1CCOCC1
InChIInChI=1S/C19H17ClN2O2/c20-14-6-7-16-15(12-14)17(13-4-2-1-3-5-13)18(19(23)21-16)22-8-10-24-11-9-22/h1-7,12H,8-11H2,(H,21,23)
InChIKeyRFHQLFNFLXWVOZ-UHFFFAOYSA-N
MW340.81 g/mol
LogP3.69
Rot. Bonds2

About 6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one

6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one (PubChem CID 701068) has the molecular formula C19H17ClN2O2 and a molecular weight of 340.81 g/mol. Its IUPAC name is 6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one.

Molecular Properties

Compound Name6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one
PubChem CID701068
Molecular FormulaC19H17ClN2O2
Molecular Weight340.81 g/mol
Exact Mass340.10
IUPAC Name6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one
SMILESO=c1[nH]c2ccc(Cl)cc2c(-c2ccccc2)c1N1CCOCC1
InChIInChI=1S/C19H17ClN2O2/c20-14-6-7-16-15(12-14)17(13-4-2-1-3-5-13)18(19(23)21-16)22-8-10-24-11-9-22/h1-7,12H,8-11H2,(H,21,23)
InChIKeyRFHQLFNFLXWVOZ-UHFFFAOYSA-N
XLogP3.69
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.81
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one?
The IUPAC name of 6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one (CID 701068) is 6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one.
What is the SMILES notation for 6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one?
The canonical SMILES for 6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one is O=c1[nH]c2ccc(Cl)cc2c(-c2ccccc2)c1N1CCOCC1.
What is the InChIKey of 6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one?
The InChIKey is RFHQLFNFLXWVOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O2/c20-14-6-7-16-15(12-14)17(13-4-2-1-3-5-13)18(19(23)21-16)22-8-10-24-11-9-22/h1-7,12H,8-11H2,(H,21,23).
What are the key properties of 6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one?
6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one has a molecular weight of 340.81 g/mol, XLogP of 3.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-morpholin-4-yl-4-phenyl-1H-quinolin-2-one is sourced from PubChem (CID 701068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).